(E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine
TL;DR: (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine (CAS 393837-63-3) is a chemical compound with molecular formula C13H10N6O2 and molecular weight 282.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-7H-purin-6-amine
Also Known As: 6-[(E)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazin-1-yl]-9H-purine, F0704-0020, (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine, 6-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-9H-purine, N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-7H-purin-6-amine
| Molecular Formula | C13H10N6O2 |
|---|---|
| Molecular Weight | 282.09 g/mol |
| LogP | 1.5276 |
| Topological Polar Surface Area | 97.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.08652 |
| Heavy Atoms | 21 |
| Complexity | 828.3945 |
Chemical Identifiers
| CAS Number | 393837-63-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=N/NC3=NC=NC4=C3NC=N4 |
Product Overview
(E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine (CAS 393837-63-3), with molecular formula C13H10N6O2 and molecular weight 282.09 g/mol. IUPAC: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-7H-purin-6-amine.
Chemical Property Profile of (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine
Property Insights of (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine
The XLogP value of 1.5276 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine. The TPSA of 97.31 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine. Following Lipinski's Rule of Five, (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine?
The CAS number of (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine is 393837-63-3.
What is the molecular formula of (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine?
The molecular formula of (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine is C13H10N6O2.
What is the molecular weight of (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine?
The molecular weight of (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine is 282.09 g/mol.
Where can I buy (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine?
You can request a quote for (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine?
Yes, KEHONG BIO provides custom synthesis services for (E)-6-(2-(benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl)-9H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.